SCHEMBL26643265

SCHEMBL26643265

O=C(O)c1cc(Cl)ccc1-n1ncc(Br)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 3/20 0.50
NR4A1 P22736 2/20 0.50
ALDH1A1 P00352 4/20 0.45
TP53 P04637 2/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 2/20 0.41
CASP1 P29466 1/20 0.41
NOTUM Q6P988 2/20 0.40
LMNA P02545 2/20 0.38
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 2/20 0.38
DHODH Q02127 1/20 0.38
GAA P10253 2/20 0.38
RPA1 P27694 1/20 0.37
MARS1 P56192 1/20 0.37
HPGD P15428 2/20 0.36
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16114726 0.80 ALDH1A1 (0.45) MYCNR4A1ALDH1A1TSHRPOLB
SCHEMBL1586432 0.80 MYC (0.57) MYCNR4A1ALDH1A1TP53CA1
SCHEMBL30644067 0.80 MYC (0.57) MYCNR4A1ALDH1A1TP53CA1
SCHEMBL26769876 0.77 MAPK14 (0.39) MYCNR4A1ALDH1A1LMNAKDM4E
SCHEMBL19207007 0.76 MYC (0.53) MYCNR4A1ALDH1A1TP53CA1
SCHEMBL23354829 0.72 RPA1 (0.53) ALDH1A1SMN1; SMN2TSHRCASP1NOTUM
SCHEMBL11403381 0.70 MYC (0.57) MYCNR4A1ALDH1A1TP53CA1
SCHEMBL23354803 0.70 MARS1 (0.44) MYCNR4A1SMN1; SMN2LMNARPA1
SCHEMBL26643209 0.70 MYC (0.56) MYCNR4A1ALDH1A1TP53CA1
SCHEMBL16655218 0.69 MYC (0.51) MYCNR4A1ALDH1A1TP53CA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023218023-A1 THIAZOLOARYL-METHYL SUBSTITUTED CYCLIC HYDRAZINE-N-CARBOXAMIDE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2023-11-16 WO disclosed